BDBM47659 4-(4-tert-butylphenyl)-2-(4-chlorophenyl)sulfanyl-4-oxidanylidene-butanoic acid::4-(4-tert-butylphenyl)-2-(4-chlorophenyl)sulfanyl-4-oxobutanoic acid::4-(4-tert-butylphenyl)-2-[(4-chlorophenyl)thio]-4-keto-butyric acid::4-(4-tert-butylphenyl)-2-[(4-chlorophenyl)thio]-4-oxobutanoic acid::4-[4-(tert-butyl)phenyl]-2-[(4-chlorophenyl)sulfanyl]-4-oxobutanoic acid::MLS000736249::SMR000338499::cid_4251978

SMILES CC(C)(C)c1ccc(cc1)C(=O)CC(Sc1ccc(Cl)cc1)C(O)=O

InChI Key InChIKey=LWFKAUBYCJNQTD-UHFFFAOYSA-N

Data  1 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 47659   

LigandPNGBDBM47659(SMR000338499 | MLS000736249 | 4-[4-(tert-butyl)phe...)
Affinity DataEC50:  3.51E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-re...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay
TargetMitochondrial import inner membrane translocase subunit TIM10(Baker's yeast)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM47659(SMR000338499 | MLS000736249 | 4-[4-(tert-butyl)phe...)
Affinity DataIC50: 2.76E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, CA...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/2/2011
Entry Details
PCBioAssay
TargetHeat shock factor protein 1(Mouse)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM47659(SMR000338499 | MLS000736249 | 4-[4-(tert-butyl)phe...)
Affinity DataEC50:  1.37E+5nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/30/2011
Entry Details
PCBioAssay